1,3-Diethyl-2-oxo-2,3-dihydro-1H-benzoimidazole-5-carboxylic acid
TL;DR: 1,3-Diethyl-2-oxo-2,3-dihydro-1H-benzoimidazole-5-carboxylic acid (CAS 14624-86-3) is a chemical compound with molecular formula C12H14N2O3 and molecular weight 234.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-diethyl-2-oxobenzimidazole-5-carboxylic acid
Also Known As: 1,3-Diethyl-2-oxo-2,3-dihydro-1H-benzoimidazole-5-carboxylic acid, 1,3-diethyl-2-oxobenzimidazole-5-carboxylic acid, ASN 14391148, BB 0217062, 1,3-diethyl-2-oxo-benzimidazole-5-carboxylic acid
| Molecular Formula | C12H14N2O3 |
|---|---|
| Molecular Weight | 234.10 g/mol |
| LogP | 1.541 |
| Topological Polar Surface Area | 64.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 234.10045 |
| Heavy Atoms | 17 |
| Complexity | 636.9735 |
Chemical Identifiers
| CAS Number | 14624-86-3 |
|---|---|
| SMILES | CCN1C2=C(C=C(C=C2)C(=O)O)N(C1=O)CC |
Product Overview
1,3-Diethyl-2-oxo-2,3-dihydro-1H-benzoimidazole-5-carboxylic acid (CAS 14624-86-3), with molecular formula C12H14N2O3 and molecular weight 234.10 g/mol. IUPAC: 1,3-diethyl-2-oxobenzimidazole-5-carboxylic acid.
Chemical Property Profile of 1,3-Diethyl-2-oxo-2,3-dihydro-1H-benzoimidazole-5-carboxylic acid
Property Insights of 1,3-Diethyl-2-oxo-2,3-dihydro-1H-benzoimidazole-5-carboxylic acid
The XLogP value of 1.541 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3-Diethyl-2-oxo-2,3-dihydro-1H-benzoimidazole-5-carboxylic acid. The TPSA of 64.23 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3-Diethyl-2-oxo-2,3-dihydro-1H-benzoimidazole-5-carboxylic acid. Following Lipinski's Rule of Five, 1,3-Diethyl-2-oxo-2,3-dihydro-1H-benzoimidazole-5-carboxylic acid has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1,3-Diethyl-2-oxo-2,3-dihydro-1H-benzoimidazole-5-carboxylic acid?
The CAS number of 1,3-Diethyl-2-oxo-2,3-dihydro-1H-benzoimidazole-5-carboxylic acid is 14624-86-3.
What is the molecular formula of 1,3-Diethyl-2-oxo-2,3-dihydro-1H-benzoimidazole-5-carboxylic acid?
The molecular formula of 1,3-Diethyl-2-oxo-2,3-dihydro-1H-benzoimidazole-5-carboxylic acid is C12H14N2O3.
What is the molecular weight of 1,3-Diethyl-2-oxo-2,3-dihydro-1H-benzoimidazole-5-carboxylic acid?
The molecular weight of 1,3-Diethyl-2-oxo-2,3-dihydro-1H-benzoimidazole-5-carboxylic acid is 234.10 g/mol.
Where can I buy 1,3-Diethyl-2-oxo-2,3-dihydro-1H-benzoimidazole-5-carboxylic acid?
You can request a quote for 1,3-Diethyl-2-oxo-2,3-dihydro-1H-benzoimidazole-5-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Diethyl-2-oxo-2,3-dihydro-1H-benzoimidazole-5-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Diethyl-2-oxo-2,3-dihydro-1H-benzoimidazole-5-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.